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Novaluron structure
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Novaluron

TL;DR: Novaluron (CAS 116714-46-6) is a chemical compound with molecular formula C17H9ClF8N2O4 and molecular weight 492.0123 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[[3-chloro-4-[1,1,2-trifluoro-2-(trifluoromethoxy)ethoxy]phenyl]carbamoyl]-2,6-difluorobenzamide

Also Known As: Novaluron, Rimon, Pedestal, Novaluron [ISO], difluorobenzamide

CAS Number
116714-46-6
Molecular Formula
C17H9ClF8N2O4
Molecular Weight
492.0123 g/mol
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Application Areas

Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1810 patents) Biotechnology (5 patents) Catalysts (18 patents) Coatings & Adhesives (3 patents) Food Additives (5 patents)

Technical Specifications

Molecular FormulaC17H9ClF8N2O4
Molecular Weight492.0123 g/mol
XLogP5.8
Topological Polar Surface Area (TPSA)76.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors12
Rotatable Bonds6
Exact Mass492.0123 Da
Heavy Atoms32
Complexity661.0
Melting Point176-179 °C
Density1.66 g/cu cm
Vapor Pressure0.00000375 [mmHg]
SolubilitySoluble in organic solvents
SMILESC1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC(=C(C=C2)OC(C(OC(F)(F)F)F)(F)F)Cl)F
InChIKeyNJPPVKZQTLUDBO-UHFFFAOYSA-N

Chemical Property Profile of Novaluron

XLogP
5.8
TPSA (Topological Polar Surface Area)
76.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
12
Rotatable Bonds
6
Heavy Atoms
32
Complexity
661.0
Exact Mass
492.0123
Monoisotopic Mass
492.0123
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Novaluron

The XLogP value of 5.8 indicates that Novaluron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Novaluron. Following Lipinski's Rule of Five, Novaluron has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Novaluron?

The CAS number of Novaluron is 116714-46-6.

What is the molecular formula of Novaluron?

The molecular formula of Novaluron is C17H9ClF8N2O4.

What is the molecular weight of Novaluron?

The molecular weight of Novaluron is 492.0123 g/mol.

Where can I buy Novaluron?

You can request a quote for Novaluron directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Novaluron?

Yes, CoreyChem provides custom synthesis services for Novaluron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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